Chem
J-GLOBAL ID：200907084323720214   Nikkaji number：J453.971K

(2R,4S,5S)-N-Isobutyl-5-[[N-[3-(1-naphthyl)-L-alanyl]-L-norleucyl]amino]-2-ethyl-4-hydroxy-6-cyclohexylhexanamide

(2R,4S,5S)-N-イソブチル-5-[[N-[3-(1-ナフチル)-L-アラニル]-L-ノルロイシル]アミノ]-2-エチル-4-ヒドロキシ-6-シクロヘキシルヘキサンアミド
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C37H58N4O4
Molecular formula furigana： C37-H58-N4-O4
Molecular weight： 622.895
InChI： InChI=1S/C37H58N4O4/c1-5-7-20-32(40-36(44)31(38)22-29-18-13-17-28-16-11-12-19-30(28)29)37(45)41-33(21-26-14-9-8-10-15-26)34(42)23-27(6-2)35(43)39-24-25(3)4/h11-13,16-19,25-27,31-34,42H,5-10,14-15,20-24,38H2,1-4H3,(H,39,43)(H,40,44)(H,41,45)/t27-,31+,32+,33+,34+/m1/s1
InChI key： WORLIUJAUIDMNX-IUJFHHLOSA-N
SMILES： CCCC[C@H](NC(=O)[C@@H](N)Cc1cccc2ccccc12)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C[C@@H](CC)C(=O)NCC(C)C
Systematic name  (3)：
  • (2R,4S,5S)-N-イソブチル-5-[[N-[3-(1-ナフチル)-L-アラニル]-L-ノルロイシル]アミノ]-2-エチル-4-ヒドロキシ-6-シクロヘキシルヘキサンアミド
  • (2R,4S,5S)-5-[(2S)-2-[(2S)-2-アミノ-3-(ナフタレン-1-イル)プロパンアミド]ヘキサンアミド]-6-シクロヘキシル-2-エチル-4-ヒドロキシ-N-(2-メチルプロピル)ヘキサンアミド
  • (2R,4S,5S)-5-[(2S)-2-[(2S)-2-amino-3-(naphthalen-1-yl)propanamido]hexanamido]-6-cyclohexyl-2-ethyl-4-hydroxy-N-(2-methylpropyl)hexanamide
Other name (1)：
  • (2R,4S,5S)-N-Isobutyl-5-[[N-[3-(1-naphthyl)-L-alanyl]-L-norleucyl]amino]-2-ethyl-4-hydroxy-6-cyclohexylhexanamide
Thsaurus map：
Thesaurus Map

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